(2-acetyloxy-1,4b,8-trimethyl-7-oxidanylidene-5,6-dihydrophenanthren-3-yl) ethanoate

Systemtic Name: (2-acetyloxy-1,4b,8-trimethyl-7-oxidanylidene-5,6-dihydrophenanthren-3-yl) ethanoate Openeye Name: (2-acetoxy-1,4b,8-trimethyl-7-oxo-5,6-dihydrophenanthren-3-yl) acetate CAS Name: acetic acid (2-acetyloxy-1,4b,8-trimethyl-7-oxo-5,6-dihydrophenanthren-3-yl) ester IUPAC Name: (2-acetyloxy-1,4b,8-trimethyl-7-oxo-5,6-dihydrophenanthren-3-yl) acetate Traditional Name: acetic acid (2-acetoxy-7-keto-1,4b,8-trimethyl-5,6-dihydrophenanthren-3-yl) ester Formula: C21H22O5 MolecularWeight: 354.39638

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C=CC3=C(C(=C(C=C3C2(CCC1=O)C)OC(=O)C)OC(=O)C)C

Isomeric SMILES

CC1=C2C=CC3=C(C(=C(C=C3C2(CCC1=O)C)OC(=O)C)OC(=O)C)C

InChI

InChI=1S/C21H22O5/c1-11-15-6-7-16-12(2)18(24)8-9-21(16,5)17(15)10-19(25-13(3)22)20(11)26-14(4)23/h6-7,10H,8-9H2,1-5H3